(2-butan-2-yl-4,6-dinitro-phenyl) 2-chloroethyl carbonate

Systemtic Name: (2-butan-2-yl-4,6-dinitro-phenyl) 2-chloroethyl carbonate Openeye Name: 2-chloroethyl (2,4-dinitro-6-sec-butyl-phenyl) carbonate CAS Name: carbonic acid (2-butan-2-yl-4,6-dinitrophenyl) 2-chloroethyl ester IUPAC Name: (2-butan-2-yl-4,6-dinitrophenyl) 2-chloroethyl carbonate Traditional Name: carbonic acid 2-chloroethyl (2,4-dinitro-6-sec-butyl-phenyl) ester Formula: C13H15ClN2O7 MolecularWeight: 346.7204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=CC(=C1OC(=O)OCCCl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC(=CC(=C1OC(=O)OCCCl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H15ClN2O7/c1-3-8(2)10-6-9(15(18)19)7-11(16(20)21)12(10)23-13(17)22-5-4-14/h6-8H,3-5H2,1-2H3